ChemSpider 2D Image | 2-(1-Hydroxy-2-phenylethyl)cholestan-3-one | C35H54O2

2-(1-Hydroxy-2-phenylethyl)cholestan-3-one

  • Molecular FormulaC35H54O2
  • Average mass506.802 Da
  • Monoisotopic mass506.412384 Da
  • ChemSpider ID489873

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

17-(1,5-Dimethylhexyl)-2-(1-hydroxy-2-phenylethyl)-10,13-dimethylhexadecahydrocyclopenta[a]phenanthren-3-one
2-(1-Hydroxy-2-phenylethyl)cholestan-3-on [German] [ACD/IUPAC Name]
2-(1-Hydroxy-2-phényléthyl)cholestan-3-one [French] [ACD/IUPAC Name]
2-(1-Hydroxy-2-phenylethyl)cholestan-3-one [ACD/IUPAC Name]
Cholestan-3-one, 2-(1-hydroxy-2-phenylethyl)- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.0±0.1 g/cm3
Boiling Point: 600.4±28.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 94.0±3.0 kJ/mol
Flash Point: 250.5±16.6 °C
Index of Refraction: 1.529
Molar Refractivity: 154.1±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 10.59
ACD/LogD (pH 5.5): 8.59
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 1121430.25
ACD/LogD (pH 7.4): 8.59
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 1121430.25
Polar Surface Area: 37 Å2
Polarizability: 61.1±0.5 10-24cm3
Surface Tension: 38.5±3.0 dyne/cm
Molar Volume: 499.5±3.0 cm3

Click to predict properties on the Chemicalize site


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